Information card for entry 4132537

Structure parameters

• Formula: C23 H24 Cl O4 P Pd
• Calculated formula: C23 H24 Cl O4 P Pd
• SMILES: [Pd]1(Cl)([P](c2c(OC)cccc2)(c2c(C(=[O]1)OC)cccc2)c1c(OC)cccc1)C
• Title of publication: Electron-Rich Metal Cations Enable Synthesis of High Molecular Weight, Linear Functional Polyethylenes.
• Authors of publication: Zhang, Wei; Waddell, Peter M.; Tiedemann, Margaret A.; Padilla, Christian E.; Mei, Jiajun; Chen, Liye; Carrow, Brad P.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• Journal volume: 140
• Journal issue: 28
• Pages of publication: 8841 - 8850
• a: 8.9395 ± 0.0003 Å
• b: 9.5963 ± 0.0004 Å
• c: 14.4751 ± 0.0006 Å
• α: 104.785 ± 0.001°
• β: 100.092 ± 0.001°
• γ: 106.757 ± 0.001°
• Cell volume: 1107.37 ± 0.08 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0192
• Residual factor for significantly intense reflections: 0.0187
• Weighted residual factors for significantly intense reflections: 0.0568
• Weighted residual factors for all reflections included in the refinement: 0.0581
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0497
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No